4-[(3-chlorophenyl)carbamamido]-N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[(3-chlorophenyl)carbamamido]-N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzene-1-sulfonamide
4-[(3-chlorophenyl)carbamamido]-N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8019-1591 |
| Compound Name: | 4-[(3-chlorophenyl)carbamamido]-N-[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzene-1-sulfonamide |
| Molecular Weight: | 586.93 |
| Molecular Formula: | C22 H18 Cl F3 N6 O6 S |
| Smiles: | CN1C2=C(C(N(C)C1=O)=O)C(C(N2)=O)(C(F)(F)F)NS(c1ccc(cc1)NC(Nc1cccc(c1)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4335 |
| logD: | -0.1607 |
| logSw: | -4.0358 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 131.198 |
| InChI Key: | GDZKLITWKJHMOC-NRFANRHFSA-N |